1-(2-methyl-3-prop-2-ynyl-2H-1,3-benzothiazol-6-yl)-2H-1,2,3,4-tetrazole-5-thione perchlorate

Systemtic Name: 1-(2-methyl-3-prop-2-ynyl-2H-1,3-benzothiazol-6-yl)-2H-1,2,3,4-tetrazole-5-thione perchlorate Openeye Name: 1-(2-methyl-3-prop-2-ynyl-2H-1,3-benzothiazol-6-yl)-2H-tetrazole-5-thione perchlorate CAS Name: 1-(2-methyl-3-prop-2-ynyl-2H-1,3-benzothiazol-6-yl)-2H-tetrazole-5-thione perchlorate IUPAC Name: 1-(2-methyl-3-prop-2-ynyl-2H-1,3-benzothiazol-6-yl)-2H-tetrazole-5-thione perchlorate Traditional Name: 1-(2-methyl-3-propargyl-2H-1,3-benzothiazol-6-yl)-2H-tetrazole-5-thione perchlorate Formula: C12H11ClN5O4S2- MolecularWeight: 388.82984

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C2=C(S1)C=C(C=C2)N3C(=S)N=NN3)CC#C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1N(C2=C(S1)C=C(C=C2)N3C(=S)N=NN3)CC#C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H11N5S2.ClHO4/c1-3-6-16-8(2)19-11-7-9(4-5-10(11)16)17-12(18)13-14-15-17;2-1(3,4)5/h1,4-5,7-8H,6H2,2H3,(H,13,15,18);(H,2,3,4,5)/p-1